1-chloranyl-4-methyl-1-(phenylsulfinyl)hexan-2-one

Systemtic Name: 1-chloranyl-4-methyl-1-(phenylsulfinyl)hexan-2-one Openeye Name: 1-(benzenesulfinyl)-1-chloro-4-methyl-hexan-2-one CAS Name: 1-(benzenesulfinyl)-1-chloro-4-methyl-2-hexanone IUPAC Name: 1-(benzenesulfinyl)-1-chloro-4-methylhexan-2-one Traditional Name: 1-(benzenesulfinyl)-1-chloro-4-methyl-hexan-2-one Formula: C13H17ClO2S MolecularWeight: 272.79088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)C(S(=O)C1=CC=CC=C1)Cl

Isomeric SMILES

CCC(C)CC(=O)C(S(=O)C1=CC=CC=C1)Cl

InChI

InChI=1S/C13H17ClO2S/c1-3-10(2)9-12(15)13(14)17(16)11-7-5-4-6-8-11/h4-8,10,13H,3,9H2,1-2H3